Vibrational Frequencies of Tetrachloroethylene using Lie Algebraic Framework

被引:0
|
作者
Teppala, Sreenivas [1 ,2 ]
Jaliparthi, Vijayasekhar [3 ]
机构
[1] Jawaharlal Nehru Technol Univ, Dept Math, Kakinada, India
[2] Anil Neerukonda Inst Technol & Sci ANITS, Dept Math, Visakhapatnam, India
[3] GITAM Deemed Univ, Sch Sci, Dept Math, Hyderabad, India
来源
MOMONA ETHIOPIAN JOURNAL OF SCIENCE | 2024年 / 16卷 / 02期
关键词
Vibrational frequencies; Lie algebraic framework; Vibrational Hamiltonian; Tetrachloroethylene;
D O I
10.4314/mejs.v16i2.6
中图分类号
O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];
学科分类号
07 ; 0710 ; 09 ;
摘要
This study employs a sophisticated computational approach to predict tetrachloroethylene's higher overtone vibrational frequencies (C2Cl4) 2 Cl 4 ) up to the fourth overtone. We utilize a Lie algebraic framework within the context of the vibrational Hamiltonian. The method involves replacing tetrachloroethylene's carbon-chlorine (C-Cl) bonds with unitary Lie algebras. The resulting Hamiltonian is written in terms of Casimir and Majorana's invariant operators and parameters. The derived Hamiltonian operator effectively characterizes the stretching vibrations inherent to the molecular structure. This approach enhances our understanding of the vibrational dynamics of tetrachloroethylene at higher overtones, offering valuable insights for applications in diverse scientific and technological fields.
引用
收藏
页码:281 / 288
页数:8
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